[4-(4-cyanophenyl)sulfanylcarbonylphenyl] butanoate

Systemtic Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] butanoate Openeye Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] butanoate CAS Name: butanoic acid [4-[[(4-cyanophenyl)thio]-oxomethyl]phenyl] ester IUPAC Name: [4-(4-cyanophenyl)sulfanylcarbonylphenyl] butanoate Traditional Name: butyric acid [4-[(4-cyanophenyl)thio]carbonylphenyl] ester Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCC(=O)OC1=CC=C(C=C1)C(=O)SC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H15NO3S/c1-2-3-17(20)22-15-8-6-14(7-9-15)18(21)23-16-10-4-13(12-19)5-11-16/h4-11H,2-3H2,1H3